orbital_charges     :real:2:4,6
  0.692145534488655E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.174045518651433E+001  0.156215210982446E+001
  0.199999999651128E+001  0.131945303811826E+001  0.173569887748097E+001
  0.179877421019196E+001  0.118760553213991E+001  0.186709819496233E+001
  0.708174282251237E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.694221518758308E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.694221518758308E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
 -0.930179434220161E-004 -0.302192015382650E-004  0.433680868994202E-018
 -0.184013807179764E-004 -0.133921759236840E-004  0.297071395261028E-016
  0.195606873825134E-003  0.227209117792683E-003  0.000000000000000E+000
  0.155238328834253E-003 -0.539564379374917E-004 -0.304118709382184E-016
 -0.119712939259642E-003 -0.648206511966506E-004  0.850104039450138E-004
 -0.119712939259760E-003 -0.648206511966090E-004 -0.850104039449860E-004
mermin_energy       :real:0:
 -0.816127881418373E+001
end_coords          :real:2:3,6
 -0.944362216902488E+000 -0.121490483805739E-001  0.000000000000000E+000
 -0.277231684236674E+001 -0.278628758660031E+000  0.000000000000000E+000
  0.263153225621761E+001  0.253125016718170E+000  0.000000000000000E+000
 -0.354685316412762E+001  0.137925997646206E+001  0.000000000000000E+000
  0.328270915517005E+001 -0.614444405186437E+000 -0.147306597453512E+001
  0.328270915517005E+001 -0.614444405186437E+000  0.147306597453512E+001
